5-nitro-N4-(1,3-thiazol-2-yl)-N6-[3-(trifluoromethyl)phenyl]pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N4-(1,3-thiazol-2-yl)-N6-[3-(trifluoromethyl)phenyl]pyrimidine-4,6-diamine Openeye Name: 5-nitro-N4-thiazol-2-yl-N6-[3-(trifluoromethyl)phenyl]pyrimidine-4,6-diamine CAS Name: 5-nitro-N4-(2-thiazolyl)-N6-[3-(trifluoromethyl)phenyl]pyrimidine-4,6-diamine IUPAC Name: 5-nitro-4-N-(1,3-thiazol-2-yl)-6-N-[3-(trifluoromethyl)phenyl]pyrimidine-4,6-diamine Traditional Name: [5-nitro-6-(thiazol-2-ylamino)pyrimidin-4-yl]-[3-(trifluoromethyl)phenyl]amine Formula: C14H9F3N6O2S MolecularWeight: 382.32047

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=C(C(=NC=N2)NC3=NC=CS3)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC2=C(C(=NC=N2)NC3=NC=CS3)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C14H9F3N6O2S/c15-14(16,17)8-2-1-3-9(6-8)21-11-10(23(24)25)12(20-7-19-11)22-13-18-4-5-26-13/h1-7H,(H2,18,19,20,21,22)